Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 5/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1057428 | 0.92 | TP53 (0.41) | TP53HTR2CHSD17B10KMT2ATSHR | |
| SCHEMBL1057287 | 0.91 | KDM4E (0.43) | TP53HSD17B10KMT2ATSHRKDM4E | |
| SCHEMBL1060920 | 0.89 | TP53 (0.47) | TP53HTR2CHSD17B10KMT2ATSHR | |
| SCHEMBL10314290 | 0.88 | KMT2A (0.47) | TP53HSD17B10KMT2ATSHRKDM4E | |
| SCHEMBL1060561 | 0.88 | TP53 (0.40) | TP53HTR2CHSD17B10KMT2ATSHR | |
| SCHEMBL10314377 | 0.86 | TP53 (0.41) | TP53HTR2CHSD17B10KMT2ATSHR | |
| SCHEMBL10314401 | 0.84 | KDM4E (0.41) | TP53HTR2CHSD17B10KMT2AKDM4E | |
| SCHEMBL1057527 | 0.84 | MAPT (0.53) | TP53TSHRKDM4EPOLBCACNA1B | |
| SCHEMBL1056680 | 0.83 | KDM4E (0.44) | TP53HTR2CHSD17B10KMT2ATSHR | |
| Trifluoroacetic Acid SCHEMBL1063966 | 0.83 | KMT2A (0.43) | TP53HSD17B10KMT2ATSHRKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009107850-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-09-03 | — | — | WO | disclosed |